IFLAB-ZINC04061788 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -1.7410 -2.9020 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -1.9200 0.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0720 -1.7690 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -0.5820 0.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2700 -0.7460 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 0.3420 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 0.6660 2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 1.5340 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 1.9150 3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 1.1620 1.7200 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -0.2170 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 0.4970 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4590 0.0040 -3.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.2450 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -0.4680 -2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 0.5810 -4.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 0.2460 -5.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 0.8160 -7.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 1.7250 -6.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 2.0620 -5.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 1.4870 -4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 2.2870 -7.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9400 3.2150 -7.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -2.4620 1.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -3.3120 2.6560 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -3.6510 3.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -2.4690 2.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -4.7970 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -3.9140 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -2.6400 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -2.8530 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 0.2790 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 1.8760 3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 2.5850 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 0.1680 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -1.2870 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 0.2950 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8950 1.5700 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -0.1400 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 1.3160 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -1.5420 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -0.2670 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -0.4610 -6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 0.5550 -8.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5180 2.7690 -5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 1.7450 -3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3270 3.5870 -8.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 2.7160 -7.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 4.0490 -7.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -2.3240 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -5.3560 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -5.4220 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -4.5050 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 0.0250 -1.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 54 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END